AC1NT7JQ

3-bromo-N-(3-methoxy-5-nitrophenyl)-5-thiophen-2-yl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

Also Known As: CBMicro_012377|ChemDiv1_003915|HMS598B21|BAS 01841074|BIM-0012210.P001|SR-01000436741-1|3-bromo-N-(3-methoxy-5-nitrophenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide|[3-bromo-5-(2-thienyl)-7-(trifluoromethyl)(4H,5H,6H,7H-pyrazolo[1,5-a]1,3-diaz aperhydroin-2-yl)]-N-(5-methoxy-3-nitrophenyl)carboxamide|3-bromo-N-(3-methoxy-5-nitrophenyl)-5-thiophen-2-yl-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

Molecular Formula	C19H15BrF3N5O4S
Molecular Weight	544.99805 g/mol
LogP	5.5365
Topological Polar Surface Area	111.32 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	544.99805
Monoisotopic Mass	544.99805
Heavy Atoms	33
Complexity	1214.9766

Chemical Identifiers

CAS Number	332852-67-2
SMILES	COC1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C2=NN3C(CC(NC3=C2Br)C4=CC=CS4)C(F)(F)F